Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | NOS3 | P29474 | 3/20 | 0.35 |
| ▸ | NOS1 | P29475 | 3/20 | 0.35 |
| ▸ | NOS2 | P35228 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7556275 | 1.00 | CYP1A2 (0.46) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL7556278 | 1.00 | CYP1A2 (0.46) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL7556270 | 1.00 | CYP1A2 (0.46) | CYP1A2NOS3NOS1NOS2CA1 | |
| Methyl Alcohol SCHEMBL7558065 | 0.96 | CYP1A2 (0.43) | CYP1A2NOS3NOS1NOS2CA1 | |
| Methyl Alcohol SCHEMBL7558067 | 0.96 | CYP1A2 (0.43) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL10579457 | 0.92 | CYP1A2 (0.43) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL10579461 | 0.92 | CYP1A2 (0.43) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL7556338 | 0.91 | CYP1A2 (0.37) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL7556346 | 0.91 | CYP1A2 (0.37) | CYP1A2NOS3NOS1NOS2CA1 | |
| SCHEMBL7556331 | 0.91 | CYP1A2 (0.37) | CYP1A2NOS3NOS1NOS2CA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0885861-B1 | LIQUID-CRYSTAL COMPOUNDS BEARING VINYL LINKAGES AND LIQUID-CRYSTAL COMPOSITION | CHISSO CORP SADAO NOGI (JP) | 2002-07-31 | — | — | EP | disclosed |
| EP-0885861-A1 | LIQUID-CRYSTAL COMPOUNDS BEARING VINYL LINKAGES AND LIQUID-CRYSTAL COMPOSITION | CHISSO CORPORATION (SADAO NOGI) (JP) | 1998-12-23 | — | — | EP | disclosed |